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Carpachromene
SpectraBase Compound ID 4I91vpFvR7j
InChI InChI=1S/C20H16O5/c1-20(2)8-7-13-16(25-20)10-17-18(19(13)23)14(22)9-15(24-17)11-3-5-12(21)6-4-11/h3-10,21,23H,1-2H3
InChIKey YXOATFKTEDZPFL-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C20H16O5
Exact Mass 336.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOrFrS398ME
Name Carpachromene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O5
InChI InChI=1S/C20H16O5/c1-20(2)8-7-13-16(25-20)10-17-18(19(13)23)14(22)9-15(24-17)11-3-5-12(21)6-4-11/h3-10,21,23H,1-2H3
InChIKey YXOATFKTEDZPFL-UHFFFAOYSA-N
Instrument Name JEOL JMS-AM II 50
Ionization Type EI
Literature Reference DOI 10.1021/np000406p
SMILES Oc1c2C(C=C(c3ccc(cc3)O)Oc2cc2c1C=CC(O2)(C)C)=O
SPLASH splash10-0fk9-0259000000-4c968ad0b057add14234
Source of Spectrum G4-64-SM3-Carpachromene
Wiley ID 1882828